CID 5271107

5-methyl-5h-[1,2,4]triazino[5,6-b]indol-3-amine

Structural Information

Molecular Formula
C10H9N5
SMILES
CN1C2=CC=CC=C2C3=C1N=C(N=N3)N
InChI
InChI=1S/C10H9N5/c1-15-7-5-3-2-4-6(7)8-9(15)12-10(11)14-13-8/h2-5H,1H3,(H2,11,12,14)
InChIKey
MMZHBNJVEKKZKQ-UHFFFAOYSA-N
Compound name
5-methyl-[1,2,4]triazino[5,6-b]indol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

199.0858 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.09308 142.2
[M+Na]+ 222.07502 155.2
[M-H]- 198.07852 143.3
[M+NH4]+ 217.11962 160.1
[M+K]+ 238.04896 150.0
[M+H-H2O]+ 182.08306 133.6
[M+HCOO]- 244.08400 163.4
[M+CH3COO]- 258.09965 155.5
[M+Na-2H]- 220.06047 151.5
[M]+ 199.08525 143.9
[M]- 199.08635 143.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.